COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383015
Chemical Name: (2E,5Z)-3-ethyl-5-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-2-[(2-phenylethyl)imino]-1,3-thiazolidin-4-one
Smiles: CCN1/C(=N\CCc2ccccc2)/S/C(=c/2\sc3c(n2CC)cccc3)/C1=O

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Molecular Weight: 409.58
Empirical Formula: C22H23N3OS2

Physical State: Dry powder
Available Amount: 568 mg

Lipinsky:
logP: 2.597
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 86
Number of rings: 4

     

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